Binding Thermodynamics and Interaction Patterns of Inhibitor-Major Urinary Protein-I Binding from Extensive Free-Energy Calculations: Benchmarking AMBER Force Fields - researchr publication

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Zhe Huai, Zhaoxi Shen, Zhaoxi Sun. Binding Thermodynamics and Interaction Patterns of Inhibitor-Major Urinary Protein-I Binding from Extensive Free-Energy Calculations: Benchmarking AMBER Force Fields. Journal of Chemical Information and Computer Sciences, 61(1):284-297, 2021. [doi]

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